Information card for entry 7212122

Structure parameters

• Formula: C21 H29 N9 O10
• Calculated formula: C21 H27 N9 O10
• Title of publication: Nitrate directed organized assemblies of protonated arene based tripodal receptors
• Authors of publication: Arunachalam, M.; Ghosh, Pradyut
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 5
• Pages of publication: 1621
• a: 10.5136 ± 0.0008 Å
• b: 10.8271 ± 0.0008 Å
• c: 11.7809 ± 0.0008 Å
• α: 91.09 ± 0.002°
• β: 93.523 ± 0.002°
• γ: 106.484 ± 0.001°
• Cell volume: 1282.56 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0533
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.127
• Weighted residual factors for all reflections included in the refinement: 0.1338
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No